N-(3-chloranyl-1-ethoxy-2-oxidanylidene-propyl)-4-methyl-3-nitro-benzenesulfonamide

Systemtic Name: N-(3-chloranyl-1-ethoxy-2-oxidanylidene-propyl)-4-methyl-3-nitro-benzenesulfonamide Openeye Name: N-(3-chloro-1-ethoxy-2-oxo-propyl)-4-methyl-3-nitro-benzenesulfonamide CAS Name: N-(3-chloro-1-ethoxy-2-oxopropyl)-4-methyl-3-nitrobenzenesulfonamide IUPAC Name: N-(3-chloro-1-ethoxy-2-oxopropyl)-4-methyl-3-nitrobenzenesulfonamide Traditional Name: N-(3-chloro-1-ethoxy-2-keto-propyl)-4-methyl-3-nitro-benzenesulfonamide Formula: C12H15ClN2O6S MolecularWeight: 350.7753

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(C(=O)CCl)NS(=O)(=O)C1=CC(=C(C=C1)C)[N+](=O)[O-]

Isomeric SMILES

CCOC(C(=O)CCl)NS(=O)(=O)C1=CC(=C(C=C1)C)[N+](=O)[O-]

InChI

InChI=1S/C12H15ClN2O6S/c1-3-21-12(11(16)7-13)14-22(19,20)9-5-4-8(2)10(6-9)15(17)18/h4-6,12,14H,3,7H2,1-2H3